N-(2-ethylphenyl)-2-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoylamino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[1-oxo-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]ethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetyl]amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetyl]amino]acetamide Formula: C20H26N3O2S+ MolecularWeight: 372.50434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCCC2C3=CC=CS3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C[NH+]2CCC[C@@H]2C3=CC=CS3

InChI

InChI=1S/C20H25N3O2S/c1-2-15-7-3-4-8-16(15)22-19(24)13-21-20(25)14-23-11-5-9-17(23)18-10-6-12-26-18/h3-4,6-8,10,12,17H,2,5,9,11,13-14H2,1H3,(H,21,25)(H,22,24)/p+1/t17-/m1/s1